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MolNFT v1 · #174798 · protein

Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in a closed state bound to laminaritetraose

7C6W · Sugar ABC transporter, periplasmic sugar-binding protein: “Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in a closed state bound to…”. X-ray diffraction, 5 ligands (SO2, BGC, CL), 1 pocket (best…

PDB
7C6W
Type
protein
Length
414 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sugar ABC transporter, periplasmic sugar-binding protein
UniProt
Q53W80
Ligands
SO2, BGC, CL, CO3, PO4
Pockets
1 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASugar ABC transporter, periplasmic sugar-binding proteinprotein41450% helix, 16% strandQ53W80

Ligands and binding sites

  • SO2 · Sulfur dioxide · ligand · chains A
  • BGC · beta-D-glucopyranose · sugar · 4 copies · chains A
  • CL · Chloride ion · ion · chains A
  • CO3 · Carbonate ion · ion · chains A
  • PO4 · Phosphate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15530.740.8160BGC, SO2, PO4

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7C6W · Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in a… · the same entry in another collection · chain A against A, TM-score 1.00

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